Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP1 | P03956 | 4/20 | 0.50 |
| ▸ | MMP13 | P45452 | 3/20 | 0.50 |
| ▸ | TBXAS1 | P24557 | 2/20 | 0.47 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.46 |
| ▸ | TARS1 | P26639 | 1/20 | 0.46 |
| ▸ | ADAMTS4 | O75173 | 2/20 | 0.45 |
| ▸ | MMP2 | P08253 | 2/20 | 0.45 |
| ▸ | MMP14 | P50281 | 2/20 | 0.45 |
| ▸ | ADAMTS5 | Q9UNA0 | 2/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | MEP1B | Q16820 | 1/20 | 0.44 |
| ▸ | BCL2L1 | Q07817 | 2/20 | 0.44 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 5/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.43 |
| ▸ | EGFR | P00533 | 2/20 | 0.43 |
| ▸ | NAMPT | P43490 | 1/20 | 0.43 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL5445650 | 0.73 | ALDH1A1 (0.48) | MMP1MMP13TBXAS1FFAR4TARS1 | |
| SCHEMBL16198117 | 0.73 | ALDH1A1 (0.58) | NPC1GAAHPGDRAB9ANAMPT | |
| SCHEMBL2845658 | 0.72 | LMNA (0.55) | MMP1MMP13FFAR4NPC1GAA | |
| SCHEMBL6557790 | 0.72 | MMP1 (0.50) | MMP1MMP13TBXAS1FFAR4ADAMTS4 | |
| SCHEMBL1161379 | 0.72 | EGFR (0.55) | MMP1MMP13MMP2HPGDPTGS2 | |
| SCHEMBL7749432 | 0.71 | MMP2 (0.59) | MMP1MMP13TARS1ADAMTS4MMP2 | |
| SCHEMBL3533538 | 0.71 | RAB9A (0.62) | MMP13NPC1GAAHPGDRAB9A | |
| SCHEMBL6557786 | 0.71 | ALDH1A1 (0.48) | MMP1MMP13TBXAS1FFAR4ADAMTS4 | |
| SCHEMBL5445643 | 0.71 | ALDH1A1 (0.51) | MMP1MMP13TBXAS1FFAR4ADAMTS4 | |
| SCHEMBL6558726 | 0.70 | TBXAS1 (0.49) | MMP1MMP13TBXAS1FFAR4ADAMTS4 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1436255-A1 | NOVEL COMPOUNDS AND COMPOSITIONS AS CATHEPSIN INHIBITORS | Aventis Pharmaceuticals, Inc. (US) | 2004-07-14 | — | — | EP | disclosed |
| WO-2003024924-A1 | NOVEL COMPOUNDS AND COMPOSITIONS AS CATHEPSIN INHIBITORS | AVENTIS PHARMACEUTICALS INC. (US) | 2003-03-27 | — | — | WO | disclosed |